5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione (CAS 302801-91-8) is a chemical compound with molecular formula C22H18N4O7 and molecular weight 450.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-phenylmethoxyphenyl)-(2,4,6-trioxo-1,3-diazinan-5-yl)methyl]-1,3-diazinane-2,4,6-trione
Also Known As: BAS 00337853, 5,5'-((4-(benzyloxy)phenyl)methylene)bis(pyrimidine-2,4,6(1H,3H,5H)-trione), 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione, 5-[(4-phenylmethoxyphenyl)-(2,4,6-trioxo-1,3-diazinan-5-yl)methyl]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C22H18N4O7 |
|---|---|
| Molecular Weight | 450.12 g/mol |
| LogP | 0.3136 |
| Topological Polar Surface Area | 159.77 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.11755 |
| Heavy Atoms | 33 |
| Complexity | 1059.0941 |
Chemical Identifiers
| CAS Number | 302801-91-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)C(C3C(=O)NC(=O)NC3=O)C4C(=O)NC(=O)NC4=O |
Product Overview
5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione (CAS 302801-91-8), with molecular formula C22H18N4O7 and molecular weight 450.12 g/mol. IUPAC: 5-[(4-phenylmethoxyphenyl)-(2,4,6-trioxo-1,3-diazinan-5-yl)methyl]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 0.3136 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 159.77 Ų indicates high polarity, suggesting 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione is 302801-91-8.
What is the molecular formula of 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione is C22H18N4O7.
What is the molecular weight of 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione is 450.12 g/mol.
Where can I buy 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.